A quantum-mechanical study of the relative stability under pressure of MgSiO3-ilmenite, MgSiO3-perovskite, and MgO-periclase+SiO2-stishovite assemblage

Philippe D’Arco1, Giovanni Sandrone2, Roberto Dovesi2, Edoardo Aprà3, V. R. Saunders3
1Laboratoire de Géologie de l'Ecole Normale Supéieure (URA1316), Paris Cédex, France
2Department of Inorganic Physical and Materials Chemistry, University of Torino, Torino, Italy
3Daresbury Laboratory, Science and Engineering Research Council, Daresbury, Warrington, UK

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